Quantum Chemical Bonding in Metals and Alloys: Fundamentals and Applications

Quantum Chemical Bonding in Metals and Alloys: Fundamentals and Applications

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This book provides a unified understanding of metals and their alloys from the standpoint of chemical bonding theory. This book comprises two parts, Fundamentals and Applications. In the Fundamentals part, four theoretical quantities (cohesive energy, energy fluctuation, atomic population, and atomic bonding population) obtained from molecular orbital calculations are utilized to develop a unified logic for various problems about the relationship between bonding, structure, properties, and reactions of materials. In the Applications part, various practical metallic alloys (fifteen alloys such ...